N-(4-cyanophenyl)-4-[7-(2-piperidin-2-ylethoxy)quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-cyanophenyl)-4-[7-(2-piperidin-2-ylethoxy)quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[7-[2-(2-piperidyl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-cyanophenyl)-4-[7-[2-(2-piperidinyl)ethoxy]-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[7-(2-piperidin-2-ylethoxy)quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[7-[2-(2-piperidyl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Formula: C27H31N7O2 MolecularWeight: 485.58074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)CCOC2=CC3=C(C=C2)C(=NC=N3)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C#N

Isomeric SMILES

C1CCNC(C1)CCOC2=CC3=C(C=C2)C(=NC=N3)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H31N7O2/c28-18-20-4-6-22(7-5-20)32-27(35)34-14-12-33(13-15-34)26-24-9-8-23(17-25(24)30-19-31-26)36-16-10-21-3-1-2-11-29-21/h4-9,17,19,21,29H,1-3,10-16H2,(H,32,35)